Name: title compound
SMILES:
Cc1cc(-c2c(C)c(CN3CCOCC3)n3ncnc(N)c23)ccc1NC(=O)Nc1cc(C(F)(F)F)ccn1Molecular Processing
Molecular formula
C26H27F3N8O2
Molecular weight
540.55
Exact mass
540.2209
XLogP
4.49
TPSA
122.7
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
39
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
140.29
Supplementary Information
Details werden geladen…
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